N'-[6-[(3-bromophenyl)amino]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide

Systemtic Name: N'-[6-[(3-bromophenyl)amino]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide Openeye Name: N'-[6-(3-bromoanilino)-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide CAS Name: N'-[6-(3-bromoanilino)-5-nitro-4-pyrimidinyl]-3-pyridinecarbohydrazide IUPAC Name: N'-[6-(3-bromoanilino)-5-nitropyrimidin-4-yl]pyridine-3-carbohydrazide Traditional Name: N'-[6-(3-bromoanilino)-5-nitro-pyrimidin-4-yl]nicotinohydrazide Formula: C16H12BrN7O3 MolecularWeight: 430.21558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=C(C(=NC=N2)NNC(=O)C3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=C(C(=NC=N2)NNC(=O)C3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrN7O3/c17-11-4-1-5-12(7-11)21-14-13(24(26)27)15(20-9-19-14)22-23-16(25)10-3-2-6-18-8-10/h1-9H,(H,23,25)(H2,19,20,21,22)